CID 59112348

Schembl14265441

Structural Information

Molecular Formula
C12H18ClF9Si
SMILES
CCC[Si](CCC)(CCC(C(C(C(F)(F)F)(F)F)(F)F)(F)F)Cl
InChI
InChI=1S/C12H18ClF9Si/c1-3-6-23(13,7-4-2)8-5-9(14,15)10(16,17)11(18,19)12(20,21)22/h3-8H2,1-2H3
InChIKey
ZBMGVZCKFPZPTA-UHFFFAOYSA-N
Compound name
chloro-(3,3,4,4,5,5,6,6,6-nonafluorohexyl)-dipropylsilane
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

2
Patents

396.07227 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 397.07955 179.2
[M+Na]+ 419.06149 186.9
[M-H]- 395.06499 168.3
[M+NH4]+ 414.10609 191.8
[M+K]+ 435.03543 181.3
[M+H-H2O]+ 379.06953 168.3
[M+HCOO]- 441.07047 179.2
[M+CH3COO]- 455.08612 219.4
[M+Na-2H]- 417.04694 181.2
[M]+ 396.07172 169.8
[M]- 396.07282 169.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe